CAS 911293-26-0

1,1-Dimethylethyl N-(4-bromophenyl)-N-phenylcarbamate

Description:

1,1-Dimethylethyl N-(4-bromophenyl)-N-phenylcarbamate, identified by its CAS number 911293-26-0, is an organic compound characterized by its carbamate functional group. This substance features a tert-butyl group (1,1-dimethylethyl) attached to a nitrogen atom, which is also bonded to two aromatic rings: a 4-bromophenyl group and a phenyl group. The presence of the bromine atom introduces a halogen, which can influence the compound's reactivity and physical properties, such as solubility and boiling point. The compound is likely to exhibit moderate to high lipophilicity due to its bulky tert-butyl group and aromatic structures, which may affect its behavior in biological systems and its potential applications in fields like agrochemicals or pharmaceuticals. Additionally, the presence of the carbamate moiety suggests potential for interactions with biological targets, making it of interest for further study in medicinal chemistry. Safety and handling precautions should be observed, as with many organic compounds, due to potential toxicity or environmental impact.

Formula: C₁₇H₁₈BrNO₂

InChI: InChI=1S/C17H18BrNO2/c1-17(2,3)21-16(20)19(14-7-5-4-6-8-14)15-11-9-13(18)10-12-15/h4-12H,1-3H3

InChI key: InChIKey=LSAQBBSMSWPVOL-UHFFFAOYSA-N

SMILES: N(C(OC(C)(C)C)=O)(C1=CC=C(Br)C=C1)C2=CC=CC=C2

Synonyms:

• 1,1-Dimethylethyl N-(4-bromophenyl)-N-phenylcarbamate
• Carbamic acid, N-(4-bromophenyl)-N-phenyl-, 1,1-dimethylethyl ester
• Carbamic acid, (4-bromophenyl)phenyl-, 1,1-dimethylethyl ester